Geometry & MOs

Info

ID:	436879
PubChem CID:	135212540
Reduced:	N3H19C31 (1)
Stoich.:	A3B19C31 (1)
Weight, g/mol:	603.10586
ΔH_f, kcal/mol:	177.14
Dipole, Da:	4.99
IP(EA), eV:	-8.1(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]imidazo[1,2-f]phenanthridine

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)N3C4=CC=CC=C4C5=C3N6C7=CC=CC=C7C8=CC=CC=C8C6=N5

DOS

IR

Vibrations